2-[[ethoxycarbonyl(methyl)carbamoyl]amino]-2-(4-methylsulfanylphenyl)ethanoic acid

Systemtic Name: 2-[[ethoxycarbonyl(methyl)carbamoyl]amino]-2-(4-methylsulfanylphenyl)ethanoic acid Openeye Name: 2-[[ethoxycarbonyl(methyl)carbamoyl]amino]-2-(4-methylsulfanylphenyl)acetic acid CAS Name: 2-[[[ethoxycarbonyl(methyl)amino]-oxomethyl]amino]-2-[4-(methylthio)phenyl]acetic acid IUPAC Name: 2-[[ethoxycarbonyl(methyl)carbamoyl]amino]-2-(4-methylsulfanylphenyl)acetic acid Traditional Name: 2-[[carbethoxy(methyl)carbamoyl]amino]-2-[4-(methylthio)phenyl]acetic acid Formula: C14H18N2O5S MolecularWeight: 326.36812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(C)C(=O)NC(C1=CC=C(C=C1)SC)C(=O)O

Isomeric SMILES

CCOC(=O)N(C)C(=O)NC(C1=CC=C(C=C1)SC)C(=O)O

InChI

InChI=1S/C14H18N2O5S/c1-4-21-14(20)16(2)13(19)15-11(12(17)18)9-5-7-10(22-3)8-6-9/h5-8,11H,4H2,1-3H3,(H,15,19)(H,17,18)